(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl (2R,4R)-1-(4-fluorophenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl (2R,4R)-1-(4-fluorophenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: (2-ethoxycarbonylbenzofuran-3-yl)methyl (2R,4R)-1-(4-fluorophenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2R,4R)-1-(4-fluorophenyl)sulfonyl-4-hydroxy-2-pyrrolidinecarboxylic acid (2-ethoxycarbonyl-3-benzofuranyl)methyl ester IUPAC Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl (2R,4R)-1-(4-fluorophenyl)sulfonyl-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2R,4R)-1-(4-fluorophenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylic acid (2-carbethoxybenzofuran-3-yl)methyl ester Formula: C23H22FNO8S MolecularWeight: 491.486083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3CC(CN3S(=O)(=O)C4=CC=C(C=C4)F)O

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)[C@H]3C[C@H](CN3S(=O)(=O)C4=CC=C(C=C4)F)O

InChI

InChI=1S/C23H22FNO8S/c1-2-31-23(28)21-18(17-5-3-4-6-20(17)33-21)13-32-22(27)19-11-15(26)12-25(19)34(29,30)16-9-7-14(24)8-10-16/h3-10,15,19,26H,2,11-13H2,1H3/t15-,19-/m1/s1